#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b6f n VAL 2 N 0.00 0.00 -5.01 1.61 0.24 -1.26 -4.28 118.33 109.63 1b6f n VAL 2 Ca 0.00 0.00 -0.31 0.00 -2.04 0.00 0.00 64.34 61.99 1b6f n VAL 2 Cb 0.00 0.00 -0.14 0.00 -1.47 0.00 0.00 33.84 32.23 1b6f n VAL 2 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 1b6f s PHE 3 N -0.62 2.48 -0.04 6.34 0.08 0.27 -4.91 117.98 121.58 1b6f s PHE 3 Ca 0.00 -0.32 0.03 0.00 0.12 0.00 0.00 56.93 56.76 1b6f s PHE 3 Cb 0.00 -1.51 -0.03 0.00 -0.57 0.00 0.00 43.02 40.91 1b6f s PHE 3 CO 0.00 0.10 -0.11 -0.80 -0.10 0.00 0.00 175.22 174.31 1b6f s ASN 4 N -0.89 4.30 -0.38 1.36 -0.87 -1.26 0.12 114.94 117.33 1b6f s ASN 4 Ca 0.12 -0.15 0.12 0.00 -1.57 0.00 0.00 52.86 51.37 1b6f s ASN 4 Cb -0.10 -0.97 0.38 0.00 -0.02 0.00 0.00 41.25 40.54 1b6f s ASN 4 CO 0.01 0.33 0.97 -1.22 -2.57 0.00 0.00 177.10 174.62 1b6f n TYR 5 N 2.09 -0.58 -2.85 2.20 4.01 0.37 -4.97 117.16 117.43 1b6f n TYR 5 Ca -0.17 -2.89 -0.34 0.00 -0.16 0.00 0.00 57.90 54.34 1b6f n TYR 5 Cb 0.52 0.32 -0.07 0.00 -0.31 0.00 0.00 39.34 39.81 1b6f n TYR 5 CO 0.00 0.00 0.00 -2.00 -0.46 0.00 0.00 176.86 174.40 1b6f s GLU 6 N -1.67 4.27 0.29 -0.72 -6.30 -1.25 -3.56 118.70 109.76 1b6f s GLU 6 Ca 0.30 1.11 -0.10 0.00 -2.50 0.00 0.00 54.97 53.78 1b6f s GLU 6 Cb 0.38 -2.33 0.01 0.00 0.00 0.00 0.00 34.13 32.18 1b6f s GLU 6 CO -0.04 0.05 0.52 0.95 0.02 0.00 0.00 175.26 176.76 1b6f s THR 7 N -2.04 0.00 0.10 -1.70 -4.23 0.29 -4.92 115.64 103.13 1b6f s THR 7 Ca 0.59 -1.42 -0.18 0.00 -1.18 0.00 0.00 61.69 59.50 1b6f s THR 7 Cb -0.11 -2.42 0.04 0.00 1.34 0.00 0.00 72.50 71.35 1b6f s THR 7 CO 0.16 0.00 0.45 -1.83 -0.54 0.00 0.00 174.62 172.85 1b6f s GLU 8 N -3.52 1.06 0.05 3.99 4.04 -1.26 0.16 118.70 123.22 1b6f s GLU 8 Ca 0.24 -0.53 0.01 0.00 0.04 0.00 0.00 54.97 54.73 1b6f s GLU 8 Cb -0.01 0.47 -0.00 0.00 0.02 0.00 0.00 34.13 34.61 1b6f s GLU 8 CO 0.13 -0.41 0.05 2.41 -1.84 0.00 0.00 175.26 175.60 1b6f n THR 9 N 0.01 0.00 -4.27 1.83 -1.04 0.34 -4.94 114.28 106.21 1b6f n THR 9 Ca -0.17 -0.32 -0.15 0.00 -2.04 0.00 0.00 64.05 61.37 1b6f n THR 9 Cb 0.62 0.17 -0.10 0.00 -1.82 0.00 0.00 70.33 69.20 1b6f n THR 9 CO 0.00 0.00 0.00 0.42 -0.64 0.00 0.00 175.07 174.85 1b6f s THR 10 N -2.28 1.08 -0.19 12.58 -4.23 -1.26 -0.18 115.64 121.15 1b6f s THR 10 Ca 0.05 -2.04 -0.26 0.00 -1.18 0.00 0.00 61.69 58.26 1b6f s THR 10 Cb 0.00 -2.03 0.07 0.00 1.34 0.00 0.00 72.50 71.88 1b6f s THR 10 CO 0.04 -0.59 0.68 -0.44 -0.54 0.00 0.00 174.62 173.76 1b6f s SER 11 N -3.21 -0.69 0.13 3.99 0.01 -0.49 -4.88 113.70 108.55 1b6f s SER 11 Ca 0.21 1.15 0.27 0.00 1.31 0.00 0.00 55.95 58.89 1b6f s SER 11 Cb 0.04 1.11 0.98 0.00 0.21 0.00 0.00 66.02 68.36 1b6f s SER 11 CO 0.03 -0.36 1.84 0.55 0.41 0.00 0.00 173.24 175.71 1b6f n VAL 12 N 2.11 0.36 -2.27 3.43 3.14 -1.26 0.41 118.33 124.25 1b6f n VAL 12 Ca -0.16 -0.17 -0.35 0.00 -2.96 0.00 0.00 64.34 60.70 1b6f n VAL 12 Cb 0.56 -0.55 -0.00 0.00 -1.06 0.00 0.00 33.84 32.78 1b6f n VAL 12 CO 0.00 0.00 0.00 -0.63 -6.46 0.00 0.00 176.83 169.74 1b6f s ILE 13 N -3.06 3.18 0.57 1.55 1.09 -1.26 -3.96 121.20 119.31 1b6f s ILE 13 Ca 0.12 0.76 -0.19 0.00 -1.10 0.00 0.00 60.65 60.24 1b6f s ILE 13 Cb 0.15 -3.32 -0.04 0.00 -1.06 0.00 0.00 42.46 38.18 1b6f s ILE 13 CO 0.57 -0.13 1.20 -2.16 -0.10 0.00 0.00 174.94 174.31 1b6f s PRO 14 N -3.16 3.12 0.34 2.79 0.04 -1.26 -2.82 135.00 134.04 1b6f s PRO 14 Ca 0.71 1.80 0.17 0.00 0.04 0.00 0.00 61.00 63.72 1b6f s PRO 14 Cb -0.25 -1.99 0.48 0.00 0.04 0.00 0.00 34.50 32.78 1b6f s PRO 14 CO 0.28 -1.08 1.64 0.00 0.04 0.00 0.00 177.00 177.87 1b6f h ALA 15 N 1.06 0.88 0.06 8.56 0.00 -1.86 -1.50 119.26 126.47 1b6f h ALA 15 Ca -0.50 -0.39 -0.00 0.00 0.00 0.00 0.00 54.91 54.01 1b6f h ALA 15 Cb 1.29 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1b6f h ALA 15 CO 0.56 0.54 -0.03 0.00 0.00 0.00 0.00 179.25 180.32 1b6f h ALA 16 N 1.57 -0.08 -0.26 0.00 0.00 -1.91 -0.29 119.26 118.28 1b6f h ALA 16 Ca -0.00 -0.29 -0.08 0.00 0.00 0.00 0.00 54.91 54.54 1b6f h ALA 16 Cb 1.06 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 1b6f h ALA 16 CO 0.06 -0.13 -0.17 -0.09 0.00 0.00 0.00 179.25 178.91 1b6f h ARG 17 N -0.91 0.46 -0.01 0.00 2.43 -1.97 -2.40 114.38 111.98 1b6f h ARG 17 Ca -0.01 -0.14 -0.17 0.00 -0.81 0.00 0.00 59.98 58.85 1b6f h ARG 17 Cb 0.60 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 30.09 1b6f h ARG 17 CO 0.01 0.62 -0.77 1.25 -1.51 0.00 0.00 179.97 179.58 1b6f h LEU 18 N 0.42 0.09 0.00 3.80 6.46 -1.35 -2.23 115.31 122.50 1b6f h LEU 18 Ca 0.07 -0.07 0.00 0.00 -0.12 0.00 0.00 57.88 57.76 1b6f h LEU 18 Cb 0.55 -0.03 0.00 0.00 -0.73 0.00 0.00 40.66 40.45 1b6f h LEU 18 CO 0.04 0.82 0.00 0.33 -0.62 0.00 0.00 178.44 179.01 1b6f n PHE 19 N -3.67 0.00 -0.30 1.25 7.35 -0.12 0.27 117.46 122.24 1b6f n PHE 19 Ca -0.02 0.00 0.10 0.00 -0.76 0.00 0.00 57.45 56.77 1b6f n PHE 19 Cb 0.74 -0.41 0.26 0.00 0.35 0.00 0.00 39.48 40.41 1b6f n PHE 19 CO 0.00 0.00 0.00 -0.22 -0.76 0.00 0.00 176.76 175.78 1b6f h LYS 20 N 0.00 0.51 -0.38 -4.13 3.64 -1.60 2.16 116.57 116.78 1b6f h LYS 20 Ca 0.00 -0.03 -0.09 0.00 -1.27 0.00 0.00 60.65 59.26 1b6f h LYS 20 Cb 0.00 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 31.69 1b6f h LYS 20 CO 0.00 0.34 -0.12 0.00 -2.27 0.00 0.00 179.45 177.40 1b6f h ALA 21 N 1.62 1.08 0.00 5.00 0.00 -1.46 -0.32 119.26 125.19 1b6f h ALA 21 Ca 0.50 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 55.11 1b6f h ALA 21 Cb 0.82 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.45 1b6f h ALA 21 CO -0.43 0.57 -0.65 0.34 0.00 0.00 0.00 179.25 179.07 1b6f n PHE 22 N -4.17 0.07 0.00 0.00 -0.00 0.14 -0.99 117.46 112.51 1b6f n PHE 22 Ca 0.01 0.02 0.00 0.00 -0.00 0.00 0.00 57.45 57.48 1b6f n PHE 22 Cb 0.35 -0.26 0.00 0.00 -0.00 0.00 0.00 39.48 39.57 1b6f n PHE 22 CO 0.00 0.00 0.00 -0.89 -0.00 0.00 0.00 176.76 175.87 1b6f n ILE 23 N -1.60 0.00 -0.15 -2.13 2.08 0.70 -3.43 119.36 114.83 1b6f n ILE 23 Ca 0.05 0.27 -0.11 0.00 0.56 0.00 0.00 62.75 63.51 1b6f n ILE 23 Cb 0.35 -1.27 -0.01 0.00 -0.75 0.00 0.00 39.64 37.97 1b6f n ILE 23 CO 0.00 0.00 0.00 -0.07 0.56 0.00 0.00 176.55 177.04 1b6f h LEU 24 N 0.00 0.94 0.00 1.39 3.38 -1.27 -2.98 115.31 116.76 1b6f h LEU 24 Ca 0.00 -0.39 0.00 0.00 0.09 0.00 0.00 57.88 57.58 1b6f h LEU 24 Cb 0.00 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.49 1b6f h LEU 24 CO 0.00 1.11 -0.51 0.44 0.09 0.00 0.00 178.44 179.58 1b6f h ASP 25 N 0.76 0.00 -0.98 -0.43 5.19 -1.29 -3.33 116.42 116.34 1b6f h ASP 25 Ca 0.11 -0.03 0.14 0.00 -0.62 0.00 0.00 57.03 56.62 1b6f h ASP 25 Cb 0.74 0.00 -0.09 0.00 0.18 0.00 0.00 39.33 40.16 1b6f h ASP 25 CO 0.06 0.02 0.60 1.23 -3.12 0.00 0.00 179.24 178.02 1b6f h GLY 26 N 4.12 1.64 1.32 2.75 0.00 -0.89 1.18 103.07 113.18 1b6f h GLY 26 Ca 0.00 -0.38 0.07 0.00 0.00 0.00 0.00 47.33 47.02 1b6f h GLY 26 CO 0.00 0.08 0.27 -0.55 0.00 0.00 0.00 176.54 176.34 1b6f h ASP 27 N 0.89 0.00 0.00 0.19 5.19 -1.67 0.52 116.42 121.54 1b6f h ASP 27 Ca 0.51 0.00 -0.07 0.00 -0.62 0.00 0.00 57.03 56.85 1b6f h ASP 27 Cb 0.60 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.10 1b6f h ASP 27 CO -0.31 0.00 -1.61 0.59 -3.12 0.00 0.00 179.24 174.79 1b6f n ASN 28 N -3.83 2.30 0.04 6.45 3.02 0.10 -4.53 115.26 118.80 1b6f n ASN 28 Ca 0.03 0.00 -0.05 0.00 -0.03 0.00 0.00 54.58 54.54 1b6f n ASN 28 Cb 0.41 1.29 -0.10 0.00 -0.61 0.00 0.00 39.78 40.77 1b6f n ASN 28 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 1b6f h LEU 29 N 0.00 0.00 0.42 3.41 4.07 0.19 -3.22 115.31 120.18 1b6f h LEU 29 Ca -0.10 0.00 -0.01 0.00 0.08 0.00 0.00 57.88 57.85 1b6f h LEU 29 Cb 0.92 0.00 -0.03 0.00 1.08 0.00 0.00 40.66 42.63 1b6f h LEU 29 CO 0.01 0.85 -0.51 -0.26 -1.08 0.00 0.00 178.44 177.44 1b6f h PHE 30 N 0.00 -1.43 0.00 1.13 -1.00 -0.17 0.15 116.94 115.63 1b6f h PHE 30 Ca -0.13 0.02 0.00 0.00 2.81 0.00 0.00 57.97 60.67 1b6f h PHE 30 Cb 1.76 0.57 0.00 0.00 3.61 0.00 0.00 35.95 41.89 1b6f h PHE 30 CO 0.00 -0.66 0.00 -0.35 -1.61 0.00 0.00 178.31 175.69 1b6f n PRO 31 N -5.55 0.67 -0.00 1.51 -0.04 -1.26 -1.99 135.00 128.34 1b6f n PRO 31 Ca -0.11 0.00 -0.00 0.00 -0.04 0.00 0.00 63.50 63.35 1b6f n PRO 31 Cb 0.45 -1.49 -0.00 0.00 -0.04 0.00 0.00 33.50 32.42 1b6f n PRO 31 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 1b6f n LYS 32 N -0.99 0.01 -0.02 0.54 3.00 -0.11 -3.97 118.16 116.62 1b6f n LYS 32 Ca 0.16 0.10 0.05 0.00 -0.00 0.00 0.00 58.31 58.62 1b6f n LYS 32 Cb 0.07 -0.62 0.26 0.00 0.00 0.00 0.00 35.03 34.74 1b6f n LYS 32 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.40 178.73 1b6f n VAL 33 N -2.47 0.07 -2.79 3.15 0.24 -0.33 -4.12 118.33 112.08 1b6f n VAL 33 Ca -0.00 -0.08 -0.10 0.00 -2.04 0.00 0.00 64.34 62.12 1b6f n VAL 33 Cb 0.01 -0.05 0.06 0.00 -1.47 0.00 0.00 33.84 32.39 1b6f n VAL 33 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1b6f n ALA 34 N -0.43 -0.70 1.20 2.33 0.00 -0.84 -4.82 120.51 117.25 1b6f n ALA 34 Ca 0.08 -1.65 0.10 0.00 0.00 0.00 0.00 53.44 51.97 1b6f n ALA 34 Cb 0.08 -1.20 0.59 0.00 0.00 0.00 0.00 19.45 18.93 1b6f n ALA 34 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1b6f n PRO 35 N 0.88 0.53 0.00 0.00 -0.04 -1.25 -2.59 135.00 132.53 1b6f n PRO 35 Ca 0.09 0.03 0.13 0.00 -0.04 0.00 0.00 63.50 63.72 1b6f n PRO 35 Cb 0.66 -1.50 0.40 0.00 -0.04 0.00 0.00 33.50 33.03 1b6f n PRO 35 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40 1b6f n GLN 36 N -1.10 1.11 0.00 0.54 7.27 -1.26 -4.57 117.38 119.37 1b6f n GLN 36 Ca 0.14 -0.67 0.00 0.00 0.07 0.00 0.00 57.00 56.54 1b6f n GLN 36 Cb 0.10 -1.49 0.00 0.00 2.41 0.00 0.00 30.24 31.27 1b6f n GLN 36 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1b6f n ALA 37 N -0.36 1.55 -2.82 1.69 0.00 -1.07 -4.95 120.51 114.55 1b6f n ALA 37 Ca 0.14 -0.10 -0.37 0.00 0.00 0.00 0.00 53.44 53.12 1b6f n ALA 37 Cb 0.36 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.75 1b6f n ALA 37 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1b6f s ILE 38 N -0.84 5.44 -0.13 0.00 1.09 -1.24 -4.10 121.20 121.41 1b6f s ILE 38 Ca 0.00 0.29 -0.26 0.00 -1.10 0.00 0.00 60.65 59.58 1b6f s ILE 38 Cb 0.00 -3.45 -0.26 0.00 -1.06 0.00 0.00 42.46 37.69 1b6f s ILE 38 CO 0.00 0.59 0.71 -1.28 -0.10 0.00 0.00 174.94 174.86 1b6f h SER 39 N 5.19 0.09 -5.18 3.58 0.87 0.21 -3.40 113.55 114.92 1b6f h SER 39 Ca -0.53 -0.92 0.08 0.00 -1.23 0.00 0.00 61.79 59.19 1b6f h SER 39 Cb 1.22 -0.03 -0.03 0.00 -0.44 0.00 0.00 62.40 63.12 1b6f h SER 39 CO 0.61 1.16 0.40 -0.55 -0.53 0.00 0.00 176.83 177.92 1b6f s SER 40 N -6.46 -0.05 0.03 6.23 0.15 -0.73 -4.84 113.70 108.04 1b6f s SER 40 Ca -0.19 -0.84 0.02 0.00 0.70 0.00 0.00 55.95 55.64 1b6f s SER 40 Cb -0.01 0.67 -0.02 0.00 -1.71 0.00 0.00 66.02 64.96 1b6f s SER 40 CO 0.70 -1.32 -0.08 0.68 1.20 0.00 0.00 173.24 174.43 1b6f s VAL 41 N -2.56 0.56 0.11 4.45 -7.23 -1.26 0.93 120.40 115.40 1b6f s VAL 41 Ca 0.17 -0.86 0.01 0.00 -1.81 0.00 0.00 61.98 59.49 1b6f s VAL 41 Cb -0.04 -0.58 -0.04 0.00 0.56 0.00 0.00 36.38 36.28 1b6f s VAL 41 CO 0.08 -0.22 -0.04 -0.70 -0.31 0.00 0.00 175.10 173.90 1b6f s GLU 42 N -1.18 0.87 -0.31 4.82 2.12 0.35 -4.90 118.70 120.47 1b6f s GLU 42 Ca -0.06 -1.37 -0.03 0.00 0.36 0.00 0.00 54.97 53.87 1b6f s GLU 42 Cb -0.08 -0.13 0.04 0.00 0.26 0.00 0.00 34.13 34.22 1b6f s GLU 42 CO 0.00 -0.07 0.04 1.21 -0.54 0.00 0.00 175.26 175.90 1b6f s ASN 43 N -3.05 5.03 0.01 -1.70 3.84 -1.26 0.18 114.94 117.97 1b6f s ASN 43 Ca 0.15 -1.21 -0.13 0.00 0.21 0.00 0.00 52.86 51.88 1b6f s ASN 43 Cb 0.06 -1.77 -0.33 0.00 -0.55 0.00 0.00 41.25 38.66 1b6f s ASN 43 CO -0.03 -0.28 0.89 0.40 -2.79 0.00 0.00 177.10 175.29 1b6f h ILE 44 N 6.35 1.17 -2.94 -5.21 1.08 -0.54 -3.47 117.51 113.96 1b6f h ILE 44 Ca -0.22 -2.66 0.00 0.00 -0.39 0.00 0.00 64.86 61.58 1b6f h ILE 44 Cb 1.07 2.93 0.00 0.00 -3.07 0.00 0.00 36.82 37.75 1b6f h ILE 44 CO 0.56 0.83 0.00 1.21 -0.69 0.00 0.00 178.15 180.06 1b6f n GLU 45 N -3.65 3.31 -2.76 2.37 0.00 -0.54 -4.92 120.64 114.45 1b6f n GLU 45 Ca -0.19 0.00 -0.10 0.00 0.00 0.00 0.00 57.16 56.87 1b6f n GLU 45 Cb 1.09 0.00 0.08 0.00 0.00 0.00 0.00 31.44 32.61 1b6f n GLU 45 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1b6f n GLY 46 N 5.00 0.80 0.00 8.31 0.00 -1.26 -4.74 105.19 113.31 1b6f n GLY 46 Ca 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 45.93 1b6f n GLY 46 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1b6f n ASN 47 N 0.33 3.81 -3.59 1.61 5.15 -1.26 -5.06 115.26 116.25 1b6f n ASN 47 Ca 0.07 -0.03 -0.20 0.00 -0.60 0.00 0.00 54.58 53.82 1b6f n ASN 47 Cb 0.70 0.82 0.00 0.00 -0.53 0.00 0.00 39.78 40.78 1b6f n ASN 47 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1b6f n GLY 48 N 1.97 -1.19 0.00 8.20 0.00 -1.26 -4.86 105.19 108.05 1b6f n GLY 48 Ca 0.00 0.63 0.00 0.00 0.00 0.00 0.00 46.02 46.65 1b6f n GLY 48 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1b6f n GLY 49 N -1.54 -0.51 3.56 -0.02 0.00 -1.26 -4.99 105.19 100.43 1b6f n GLY 49 Ca -0.23 -0.98 -0.32 0.00 0.00 0.00 0.00 46.02 44.49 1b6f n GLY 49 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1b6f s PRO 50 N -1.59 2.55 0.00 1.61 0.04 -1.26 -1.96 135.00 134.39 1b6f s PRO 50 Ca 0.00 0.19 0.00 0.00 0.04 0.00 0.00 61.00 61.23 1b6f s PRO 50 Cb 0.00 -4.73 0.00 0.00 0.04 0.00 0.00 34.50 29.81 1b6f s PRO 50 CO 0.00 -3.11 0.00 0.41 0.04 0.00 0.00 177.00 174.34 1b6f n GLY 51 N 6.30 0.41 3.88 0.56 0.00 -1.23 -4.97 105.19 110.13 1b6f n GLY 51 Ca 0.31 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.03 1b6f n GLY 51 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1b6f s THR 52 N -0.56 3.98 0.01 2.61 2.01 -0.83 -4.79 115.64 118.07 1b6f s THR 52 Ca 0.00 0.62 0.01 0.00 0.31 0.00 0.00 61.69 62.63 1b6f s THR 52 Cb 0.00 -3.63 -0.01 0.00 0.01 0.00 0.00 72.50 68.87 1b6f s THR 52 CO 0.00 -0.83 -0.04 -0.63 -0.69 0.00 0.00 174.62 172.43 1b6f s ILE 53 N -3.27 0.31 -0.09 1.82 1.01 -1.26 -0.44 121.20 119.27 1b6f s ILE 53 Ca 0.57 -0.44 -0.12 0.00 0.00 0.00 0.00 60.65 60.66 1b6f s ILE 53 Cb -0.11 -0.32 0.03 0.00 0.01 0.00 0.00 42.46 42.07 1b6f s ILE 53 CO 0.52 -0.10 0.31 -0.75 0.00 0.00 0.00 174.94 174.92 1b6f s LYS 54 N -0.58 0.44 -0.31 2.79 2.20 -1.06 0.23 119.74 123.45 1b6f s LYS 54 Ca -0.03 0.26 -0.19 0.00 -0.36 0.00 0.00 55.97 55.65 1b6f s LYS 54 Cb -0.04 0.21 -0.01 0.00 -1.51 0.00 0.00 37.83 36.47 1b6f s LYS 54 CO -0.00 -0.08 0.57 0.21 -0.36 0.00 0.00 175.35 175.69 1b6f s LYS 55 N -0.24 3.86 -0.28 4.03 2.20 0.13 -2.57 119.74 126.87 1b6f s LYS 55 Ca -0.04 0.17 -0.14 0.00 -0.36 0.00 0.00 55.97 55.60 1b6f s LYS 55 Cb -0.03 -3.73 -0.04 0.00 -1.51 0.00 0.00 37.83 32.51 1b6f s LYS 55 CO 0.01 -0.54 0.31 0.42 -0.36 0.00 0.00 175.35 175.19 1b6f s ILE 56 N 2.48 5.22 -0.01 5.43 -1.09 -0.04 0.13 121.20 133.32 1b6f s ILE 56 Ca 0.22 0.42 -0.27 0.00 -2.23 0.00 0.00 60.65 58.79 1b6f s ILE 56 Cb -0.15 -3.65 -0.04 0.00 -1.58 0.00 0.00 42.46 37.04 1b6f s ILE 56 CO 0.12 0.18 0.87 -0.44 -1.23 0.00 0.00 174.94 174.44 1b6f s SER 57 N 1.68 7.24 0.31 3.58 0.01 0.26 -1.57 113.70 125.23 1b6f s SER 57 Ca 0.12 1.50 0.08 0.00 1.31 0.00 0.00 55.95 58.96 1b6f s SER 57 Cb -0.16 -2.51 -0.03 0.00 0.21 0.00 0.00 66.02 63.53 1b6f s SER 57 CO 0.10 -0.18 0.21 -0.36 0.41 0.00 0.00 173.24 173.42 1b6f s PHE 58 N 0.79 2.87 0.00 2.43 0.40 -1.17 0.21 117.98 123.50 1b6f s PHE 58 Ca 0.46 -0.28 0.00 0.00 -0.60 0.00 0.00 56.93 56.51 1b6f s PHE 58 Cb -0.20 -1.62 0.00 0.00 0.51 0.00 0.00 43.02 41.71 1b6f s PHE 58 CO 0.24 0.33 0.00 -0.35 0.70 0.00 0.00 175.22 176.15 1b6f n PRO 59 N -1.23 0.07 -2.65 0.24 -0.04 -1.26 -4.60 135.00 125.53 1b6f n PRO 59 Ca -0.04 0.00 -0.30 0.00 -0.04 0.00 0.00 63.50 63.12 1b6f n PRO 59 Cb 0.60 0.00 -0.02 0.00 -0.04 0.00 0.00 33.50 34.03 1b6f n PRO 59 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 1b6f s GLU 60 N -1.76 3.77 0.00 0.54 2.56 -1.26 -4.83 118.70 117.71 1b6f s GLU 60 Ca 0.00 0.56 0.00 0.00 0.00 0.00 0.00 54.97 55.53 1b6f s GLU 60 Cb 0.00 -2.31 0.00 0.00 2.00 0.00 0.00 34.13 33.82 1b6f s GLU 60 CO 0.00 -0.15 0.00 0.41 -0.56 0.00 0.00 175.26 174.96 1b6f n GLY 61 N -1.60 -1.01 3.57 -1.50 0.00 -1.26 -5.13 105.19 98.26 1b6f n GLY 61 Ca 0.03 0.37 -0.29 0.00 0.00 0.00 0.00 46.02 46.14 1b6f n GLY 61 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1b6f s PHE 62 N 0.00 1.65 0.44 1.61 -0.12 -1.26 -4.88 117.98 115.42 1b6f s PHE 62 Ca 0.00 1.13 0.23 0.00 -0.05 0.00 0.00 56.93 58.24 1b6f s PHE 62 Cb 0.00 -3.17 1.33 0.00 -0.63 0.00 0.00 43.02 40.55 1b6f s PHE 62 CO 0.00 -3.46 2.06 -1.00 -0.05 0.00 0.00 175.22 172.77 1b6f h PRO 63 N -2.32 0.00 -7.75 1.99 0.13 -2.00 -3.43 132.00 118.62 1b6f h PRO 63 Ca -0.58 0.00 -0.45 0.00 -0.87 0.00 0.00 66.00 64.10 1b6f h PRO 63 Cb 1.33 0.00 0.16 0.00 0.13 0.00 0.00 31.00 32.62 1b6f h PRO 63 CO 0.53 0.13 0.38 0.12 -0.23 0.00 0.00 178.00 178.94 1b6f s PHE 64 N -4.36 1.36 0.00 1.56 5.36 -1.26 -5.06 117.98 115.57 1b6f s PHE 64 Ca -0.03 0.15 0.00 0.00 -0.96 0.00 0.00 56.93 56.09 1b6f s PHE 64 Cb 0.14 -4.05 0.00 0.00 -0.34 0.00 0.00 43.02 38.78 1b6f s PHE 64 CO 0.62 -2.66 0.00 1.63 -1.46 0.00 0.00 175.22 173.35 1b6f n LYS 65 N -3.70 0.00 -2.60 10.12 5.02 -1.26 -4.78 118.16 120.96 1b6f n LYS 65 Ca 0.16 0.00 -0.23 0.00 -2.02 0.00 0.00 58.31 56.22 1b6f n LYS 65 Cb 0.59 0.00 0.11 0.00 -0.02 0.00 0.00 35.03 35.71 1b6f n LYS 65 CO 0.00 0.00 0.00 1.52 -0.52 0.00 0.00 177.40 178.40 1b6f s TYR 66 N -0.67 1.58 -0.02 2.13 -0.85 -1.26 -3.05 117.35 115.21 1b6f s TYR 66 Ca 0.00 -0.29 -0.19 0.00 -0.52 0.00 0.00 57.07 56.07 1b6f s TYR 66 Cb 0.00 -2.97 0.03 0.00 0.38 0.00 0.00 41.96 39.40 1b6f s TYR 66 CO 0.00 -1.70 0.40 0.14 -1.52 0.00 0.00 175.55 172.87 1b6f s VAL 67 N -3.13 0.04 -0.07 -3.49 -7.23 -0.61 -4.43 120.40 101.49 1b6f s VAL 67 Ca 0.66 -0.36 0.01 0.00 -1.81 0.00 0.00 61.98 60.48 1b6f s VAL 67 Cb -0.05 -0.72 -0.03 0.00 0.56 0.00 0.00 36.38 36.14 1b6f s VAL 67 CO 0.44 -0.20 -0.07 -0.54 -0.31 0.00 0.00 175.10 174.42 1b6f s LYS 68 N -1.34 2.75 -0.03 4.82 1.02 0.41 -0.86 119.74 126.52 1b6f s LYS 68 Ca -0.13 -0.55 0.01 0.00 0.02 0.00 0.00 55.97 55.33 1b6f s LYS 68 Cb -0.04 -2.59 0.01 0.00 -0.52 0.00 0.00 37.83 34.69 1b6f s LYS 68 CO 0.05 0.66 -0.05 0.16 -0.92 0.00 0.00 175.35 175.25 1b6f s ASP 69 N -0.80 0.84 -0.12 2.83 -4.77 -1.06 -0.06 116.67 113.53 1b6f s ASP 69 Ca 0.12 -0.12 -0.07 0.00 -3.30 0.00 0.00 52.55 49.18 1b6f s ASP 69 Cb -0.11 -0.30 -0.04 0.00 -1.09 0.00 0.00 42.92 41.38 1b6f s ASP 69 CO 0.01 -0.00 0.14 -0.60 0.70 0.00 0.00 175.17 175.42 1b6f s ARG 70 N 0.51 3.46 0.74 2.11 3.52 0.25 -2.55 118.95 126.99 1b6f s ARG 70 Ca -0.07 -0.14 -0.15 0.00 -0.13 0.00 0.00 55.73 55.25 1b6f s ARG 70 Cb -0.10 -3.19 0.04 0.00 -1.56 0.00 0.00 34.95 30.14 1b6f s ARG 70 CO 0.00 0.76 1.22 0.08 -0.81 0.00 0.00 175.30 176.56 1b6f s VAL 71 N -0.98 2.16 0.00 7.11 1.01 0.41 0.28 120.40 130.40 1b6f s VAL 71 Ca 0.15 0.08 0.00 0.00 0.00 0.00 0.00 61.98 62.21 1b6f s VAL 71 Cb -0.12 -2.68 0.00 0.00 0.00 0.00 0.00 36.38 33.58 1b6f s VAL 71 CO 0.04 -0.04 0.00 -0.67 0.00 0.00 0.00 175.10 174.43 1b6f n ASP 72 N -2.75 0.00 -3.60 3.32 2.03 0.57 -3.55 116.55 112.57 1b6f n ASP 72 Ca 0.14 0.00 -0.23 0.00 0.52 0.00 0.00 54.79 55.22 1b6f n ASP 72 Cb 0.50 -0.22 -0.16 0.00 -0.72 0.00 0.00 41.12 40.52 1b6f n ASP 72 CO 0.00 0.00 0.00 -1.61 -1.92 0.00 0.00 177.20 173.67 1b6f s GLU 73 N -0.64 0.06 -0.08 -0.67 0.41 -0.96 -4.40 118.70 112.41 1b6f s GLU 73 Ca 0.00 0.11 -0.04 0.00 -0.41 0.00 0.00 54.97 54.63 1b6f s GLU 73 Cb 0.00 -1.34 -0.04 0.00 -1.78 0.00 0.00 34.13 30.97 1b6f s GLU 73 CO 0.00 -0.58 0.09 0.08 -0.49 0.00 0.00 175.26 174.37 1b6f s VAL 74 N 2.20 5.00 -0.07 2.63 1.01 -1.26 -1.61 120.40 128.29 1b6f s VAL 74 Ca 0.04 -0.07 -0.03 0.00 0.00 0.00 0.00 61.98 61.91 1b6f s VAL 74 Cb -0.15 -3.19 0.04 0.00 0.00 0.00 0.00 36.38 33.08 1b6f s VAL 74 CO -0.08 0.54 0.14 -0.62 0.00 0.00 0.00 175.10 175.08 1b6f s ASP 75 N -1.19 0.79 0.00 3.32 -1.08 0.61 -4.81 116.67 114.31 1b6f s ASP 75 Ca 0.17 0.28 0.25 0.00 -0.52 0.00 0.00 52.55 52.73 1b6f s ASP 75 Cb -0.12 0.18 0.84 0.00 -1.46 0.00 0.00 42.92 42.36 1b6f s ASP 75 CO 0.06 -0.24 1.62 1.41 0.52 0.00 0.00 175.17 178.54 1b6f n HIS 76 N 5.26 0.08 -0.03 -5.34 8.25 -1.26 -2.47 115.22 119.71 1b6f n HIS 76 Ca -0.05 -0.04 -0.03 0.00 -0.26 0.00 0.00 57.72 57.33 1b6f n HIS 76 Cb 0.50 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.58 1b6f n HIS 76 CO 0.00 0.00 0.00 2.41 0.64 0.00 0.00 176.34 179.39 1b6f n THR 77 N 0.42 0.33 -0.96 1.59 -1.04 -1.26 -4.63 114.28 108.74 1b6f n THR 77 Ca 0.18 -0.16 0.05 0.00 -2.04 0.00 0.00 64.05 62.08 1b6f n THR 77 Cb 0.39 -0.78 0.36 0.00 -1.82 0.00 0.00 70.33 68.48 1b6f n THR 77 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 1b6f n ASN 78 N -2.46 5.27 -4.03 8.00 5.03 -1.26 -4.95 115.26 120.86 1b6f n ASN 78 Ca -0.09 -3.01 -0.38 0.00 0.87 0.00 0.00 54.58 51.96 1b6f n ASN 78 Cb 0.63 -0.67 -0.00 0.00 -1.02 0.00 0.00 39.78 38.71 1b6f n ASN 78 CO 0.00 0.00 0.00 0.49 -1.83 0.00 0.00 177.26 175.92 1b6f n PHE 79 N 0.28 -1.50 -4.24 3.10 3.72 -1.20 -4.77 117.46 112.85 1b6f n PHE 79 Ca 0.29 0.33 -0.28 0.00 -0.05 0.00 0.00 57.45 57.74 1b6f n PHE 79 Cb 1.18 -3.04 -0.17 0.00 -0.94 0.00 0.00 39.48 36.52 1b6f n PHE 79 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 176.76 176.92 1b6f s LYS 80 N -7.04 2.09 -0.24 -1.08 2.20 -1.03 -2.33 119.74 112.32 1b6f s LYS 80 Ca 0.33 -0.50 -0.04 0.00 -0.36 0.00 0.00 55.97 55.41 1b6f s LYS 80 Cb -0.16 -1.87 0.09 0.00 -1.51 0.00 0.00 37.83 34.38 1b6f s LYS 80 CO 0.95 -0.14 0.17 -0.47 -0.36 0.00 0.00 175.35 175.49 1b6f s TYR 81 N 1.24 0.01 0.04 4.03 6.14 -0.47 0.22 117.35 128.56 1b6f s TYR 81 Ca -0.02 -0.34 0.09 0.00 0.64 0.00 0.00 57.07 57.44 1b6f s TYR 81 Cb -0.14 -0.64 -0.03 0.00 0.42 0.00 0.00 41.96 41.57 1b6f s TYR 81 CO -0.05 -0.71 -0.25 -0.80 0.64 0.00 0.00 175.55 174.38 1b6f s ASN 82 N 2.21 3.01 -0.01 4.32 0.01 -0.64 -1.15 114.94 122.69 1b6f s ASN 82 Ca 0.07 -0.56 0.02 0.00 -0.71 0.00 0.00 52.86 51.67 1b6f s ASN 82 Cb -0.16 -0.28 0.00 0.00 0.41 0.00 0.00 41.25 41.23 1b6f s ASN 82 CO -0.23 0.24 -0.05 -0.72 -1.51 0.00 0.00 177.10 174.84 1b6f s TYR 83 N -0.78 0.55 0.37 2.20 -0.85 0.46 0.21 117.35 119.51 1b6f s TYR 83 Ca 0.11 -0.11 0.01 0.00 -0.52 0.00 0.00 57.07 56.56 1b6f s TYR 83 Cb -0.10 -0.40 -0.02 0.00 0.38 0.00 0.00 41.96 41.82 1b6f s TYR 83 CO 0.02 -0.05 0.57 -1.12 -1.52 0.00 0.00 175.55 173.45 1b6f s SER 84 N 0.14 6.14 -0.20 -0.18 0.01 0.79 -1.39 113.70 119.00 1b6f s SER 84 Ca -0.01 0.34 -0.08 0.00 1.31 0.00 0.00 55.95 57.51 1b6f s SER 84 Cb -0.05 -1.82 -0.04 0.00 0.21 0.00 0.00 66.02 64.31 1b6f s SER 84 CO -0.00 -0.41 0.09 -0.69 0.41 0.00 0.00 173.24 172.63 1b6f s VAL 85 N -2.36 4.94 0.00 3.43 1.01 0.95 0.88 120.40 129.26 1b6f s VAL 85 Ca 0.42 0.03 0.00 0.00 0.00 0.00 0.00 61.98 62.43 1b6f s VAL 85 Cb -0.10 -3.25 0.00 0.00 0.00 0.00 0.00 36.38 33.03 1b6f s VAL 85 CO 0.36 0.43 0.00 2.30 0.00 0.00 0.00 175.10 178.19 1b6f n ILE 86 N 3.78 0.00 -2.30 2.22 -5.35 0.91 -4.16 119.36 114.46 1b6f n ILE 86 Ca -0.16 0.01 -0.41 0.00 -0.27 0.00 0.00 62.75 61.91 1b6f n ILE 86 Cb 0.52 -0.81 0.00 0.00 -1.74 0.00 0.00 39.64 37.61 1b6f n ILE 86 CO 0.00 0.00 0.00 1.21 -1.76 0.00 0.00 176.55 176.00 1b6f n GLU 87 N -1.89 4.32 -4.24 6.28 4.07 -1.11 -4.57 120.64 123.51 1b6f n GLU 87 Ca 0.00 -3.74 -0.14 0.00 -0.06 0.00 0.00 57.16 53.22 1b6f n GLU 87 Cb 0.00 -2.71 -0.10 0.00 -0.06 0.00 0.00 31.44 28.57 1b6f n GLU 87 CO 0.00 0.00 0.00 0.20 -0.06 0.00 0.00 177.13 177.27 1b6f s GLY 88 N 0.10 1.05 0.00 8.31 0.00 -1.26 -0.44 107.32 115.08 1b6f s GLY 88 Ca 0.44 -1.47 0.00 0.00 0.00 0.00 0.00 44.72 43.70 1b6f s GLY 88 CO -0.04 -1.57 0.00 0.61 0.00 0.00 0.00 173.10 172.10 1b6f n GLY 89 N -0.14 0.70 0.00 0.20 0.00 -1.26 -1.58 105.19 103.10 1b6f n GLY 89 Ca -0.11 -0.79 0.09 0.00 0.00 0.00 0.00 46.02 45.21 1b6f n GLY 89 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1b6f n PRO 90 N 0.00 0.69 -1.10 1.61 -0.04 -1.26 -4.87 135.00 130.03 1b6f n PRO 90 Ca 0.00 0.00 -0.35 0.00 -0.04 0.00 0.00 63.50 63.11 1b6f n PRO 90 Cb 0.00 -1.42 0.09 0.00 -0.04 0.00 0.00 33.50 32.13 1b6f n PRO 90 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 1b6f n ILE 91 N -0.92 1.17 0.00 0.52 5.41 -0.62 -4.94 119.36 119.99 1b6f n ILE 91 Ca 0.14 -0.33 0.00 0.00 1.00 0.00 0.00 62.75 63.56 1b6f n ILE 91 Cb 0.06 -0.70 0.00 0.00 -0.71 0.00 0.00 39.64 38.30 1b6f n ILE 91 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1b6f n GLY 92 N 1.61 0.90 0.00 7.39 0.00 -1.26 -4.71 105.19 109.12 1b6f n GLY 92 Ca 0.09 0.32 0.00 0.00 0.00 0.00 0.00 46.02 46.42 1b6f n GLY 92 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1b6f n ASP 93 N 0.00 0.00 -0.12 1.61 8.00 -1.26 -4.70 116.55 120.08 1b6f n ASP 93 Ca 0.00 0.18 0.00 0.00 0.71 0.00 0.00 54.79 55.68 1b6f n ASP 93 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 1b6f n ASP 93 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 1b6f n THR 94 N -0.30 0.00 -3.28 -3.53 -2.24 -1.26 -5.10 114.28 98.57 1b6f n THR 94 Ca 0.00 0.00 -0.26 0.00 -2.27 0.00 0.00 64.05 61.52 1b6f n THR 94 Cb 0.00 0.52 -0.02 0.00 -2.10 0.00 0.00 70.33 68.73 1b6f n THR 94 CO 0.00 0.00 0.00 -1.48 -0.57 0.00 0.00 175.07 173.02 1b6f s LEU 95 N 0.00 3.99 -1.64 3.22 2.34 -1.26 -4.18 118.68 121.15 1b6f s LEU 95 Ca 0.00 0.60 -0.03 0.00 0.06 0.00 0.00 54.13 54.76 1b6f s LEU 95 Cb 0.00 -3.46 0.00 0.00 -0.56 0.00 0.00 46.19 42.18 1b6f s LEU 95 CO 0.00 -0.28 0.36 -0.62 -1.06 0.00 0.00 176.35 174.74 1b6f n GLU 96 N -1.49 -3.57 -1.72 1.48 -0.58 0.74 -4.20 120.64 111.29 1b6f n GLU 96 Ca -0.03 0.94 -0.31 0.00 -0.42 0.00 0.00 57.16 57.34 1b6f n GLU 96 Cb 0.55 -5.72 0.03 0.00 -0.57 0.00 0.00 31.44 25.73 1b6f n GLU 96 CO 0.00 0.00 0.00 0.21 -0.48 0.00 0.00 177.13 176.86 1b6f s LYS 97 N -5.44 3.20 -0.05 3.49 2.20 0.41 -4.71 119.74 118.84 1b6f s LYS 97 Ca 0.18 0.92 -0.02 0.00 -0.36 0.00 0.00 55.97 56.69 1b6f s LYS 97 Cb -0.08 -2.02 0.04 0.00 -1.51 0.00 0.00 37.83 34.25 1b6f s LYS 97 CO 0.22 -0.89 0.10 0.42 -0.36 0.00 0.00 175.35 174.84 1b6f s ILE 98 N -3.02 -0.09 -0.26 5.43 1.09 -1.26 0.16 121.20 123.25 1b6f s ILE 98 Ca 0.58 0.24 -0.00 0.00 -1.10 0.00 0.00 60.65 60.36 1b6f s ILE 98 Cb -0.13 -0.19 0.04 0.00 -1.06 0.00 0.00 42.46 41.12 1b6f s ILE 98 CO 0.52 0.10 -0.06 -0.55 -0.10 0.00 0.00 174.94 174.85 1b6f s SER 99 N 1.40 4.43 -0.14 3.58 0.15 -0.92 -0.03 113.70 122.17 1b6f s SER 99 Ca -0.06 -1.09 -0.09 0.00 0.70 0.00 0.00 55.95 55.42 1b6f s SER 99 Cb -0.12 -1.64 -0.04 0.00 -1.71 0.00 0.00 66.02 62.50 1b6f s SER 99 CO -0.05 -0.17 0.17 0.20 1.20 0.00 0.00 173.24 174.59 1b6f s ASN 100 N 1.25 6.38 0.03 5.45 -0.87 -0.49 -0.66 114.94 126.04 1b6f s ASN 100 Ca -0.03 0.44 0.07 0.00 -1.57 0.00 0.00 52.86 51.77 1b6f s ASN 100 Cb -0.18 -2.10 -0.02 0.00 -0.02 0.00 0.00 41.25 38.93 1b6f s ASN 100 CO -0.04 0.32 -0.19 -1.61 -2.57 0.00 0.00 177.10 173.01 1b6f s GLU 101 N -0.56 1.31 -0.14 -0.60 2.02 0.56 -0.41 118.70 120.88 1b6f s GLU 101 Ca 0.14 -0.86 -0.03 0.00 0.02 0.00 0.00 54.97 54.24 1b6f s GLU 101 Cb -0.12 -1.38 0.05 0.00 0.10 0.00 0.00 34.13 32.78 1b6f s GLU 101 CO 0.03 0.35 0.04 0.42 0.02 0.00 0.00 175.26 176.12 1b6f s ILE 102 N -0.75 0.34 -0.15 -1.63 1.01 -0.30 -0.31 121.20 119.41 1b6f s ILE 102 Ca 0.06 -0.23 0.01 0.00 0.00 0.00 0.00 60.65 60.50 1b6f s ILE 102 Cb -0.08 -0.75 0.01 0.00 0.01 0.00 0.00 42.46 41.64 1b6f s ILE 102 CO 0.01 -0.06 -0.19 -0.75 0.00 0.00 0.00 174.94 173.96 1b6f s LYS 103 N 1.96 3.10 -0.13 2.79 2.20 -0.36 -1.37 119.74 127.93 1b6f s LYS 103 Ca 0.02 -0.81 0.02 0.00 -0.36 0.00 0.00 55.97 54.84 1b6f s LYS 103 Cb -0.15 -2.53 -0.00 0.00 -1.51 0.00 0.00 37.83 33.64 1b6f s LYS 103 CO -0.07 -0.02 -0.20 0.42 -0.36 0.00 0.00 175.35 175.12 1b6f s ILE 104 N 0.87 2.36 0.00 5.43 1.01 -0.98 -1.01 121.20 128.87 1b6f s ILE 104 Ca -0.05 -0.89 0.03 0.00 0.00 0.00 0.00 60.65 59.74 1b6f s ILE 104 Cb -0.15 -1.95 -0.01 0.00 0.01 0.00 0.00 42.46 40.36 1b6f s ILE 104 CO -0.02 0.54 -0.10 -0.69 0.00 0.00 0.00 174.94 174.67 1b6f s VAL 105 N 0.58 0.79 0.18 2.92 1.01 -0.72 -4.62 120.40 120.53 1b6f s VAL 105 Ca -0.11 -0.54 -0.17 0.00 0.00 0.00 0.00 61.98 61.15 1b6f s VAL 105 Cb -0.16 -0.68 -0.08 0.00 0.00 0.00 0.00 36.38 35.46 1b6f s VAL 105 CO 0.04 0.14 0.64 0.00 0.00 0.00 0.00 175.10 175.91 1b6f s ALA 106 N -0.40 3.50 1.00 5.51 0.00 -1.26 0.15 121.76 130.26 1b6f s ALA 106 Ca 0.02 0.03 0.00 0.00 0.00 0.00 0.00 51.96 52.01 1b6f s ALA 106 Cb -0.05 -2.68 0.00 0.00 0.00 0.00 0.00 23.12 20.40 1b6f s ALA 106 CO -0.00 0.39 0.00 0.25 0.00 0.00 0.00 175.76 176.40 1b6f n THR 107 N 0.81 0.00 0.15 0.00 -2.24 0.20 -4.83 114.28 108.37 1b6f n THR 107 Ca -0.04 0.00 0.05 0.00 -2.27 0.00 0.00 64.05 61.79 1b6f n THR 107 Cb 0.51 -1.99 0.05 0.00 -2.10 0.00 0.00 70.33 66.81 1b6f n THR 107 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 1b6f h PRO 108 N 0.00 0.00 0.00 -0.78 0.13 -1.99 -3.43 132.00 125.93 1b6f h PRO 108 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1b6f h PRO 108 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 1b6f h PRO 108 CO 0.00 0.35 0.00 -0.25 -0.23 0.00 0.00 178.00 177.87 1b6f n ASP 109 N -3.16 0.00 -2.78 1.44 9.92 -1.26 -5.03 116.55 115.69 1b6f n ASP 109 Ca 0.02 0.00 -0.03 0.00 -0.53 0.00 0.00 54.79 54.25 1b6f n ASP 109 Cb 0.69 0.00 0.05 0.00 -0.64 0.00 0.00 41.12 41.22 1b6f n ASP 109 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1b6f n GLY 110 N 0.00 1.72 3.96 0.44 0.00 -1.26 -5.12 105.19 104.92 1b6f n GLY 110 Ca 0.00 -1.04 0.00 0.00 0.00 0.00 0.00 46.02 44.98 1b6f n GLY 110 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1b6f n GLY 111 N -0.53 -0.74 3.26 -0.02 0.00 -1.25 -4.56 105.19 101.34 1b6f n GLY 111 Ca 0.06 -1.49 -0.14 0.00 0.00 0.00 0.00 46.02 44.45 1b6f n GLY 111 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1b6f s SER 112 N -4.00 1.43 -0.15 1.61 1.04 0.16 0.61 113.70 114.41 1b6f s SER 112 Ca 0.00 -1.14 -0.04 0.00 0.48 0.00 0.00 55.95 55.25 1b6f s SER 112 Cb 0.00 0.07 -0.03 0.00 0.10 0.00 0.00 66.02 66.16 1b6f s SER 112 CO 0.00 -0.51 -0.02 -0.63 0.98 0.00 0.00 173.24 173.06 1b6f s ILE 113 N -3.55 4.02 -0.13 -1.02 1.01 0.40 -1.40 121.20 120.54 1b6f s ILE 113 Ca 0.23 -0.32 -0.04 0.00 0.00 0.00 0.00 60.65 60.52 1b6f s ILE 113 Cb 0.05 -2.75 -0.03 0.00 0.01 0.00 0.00 42.46 39.73 1b6f s ILE 113 CO 0.04 0.51 0.02 -0.76 0.00 0.00 0.00 174.94 174.74 1b6f s LEU 114 N 0.16 3.63 -0.20 2.97 1.02 0.75 -1.76 118.68 125.25 1b6f s LEU 114 Ca -0.01 0.10 -0.01 0.00 0.02 0.00 0.00 54.13 54.22 1b6f s LEU 114 Cb -0.13 -1.87 0.06 0.00 0.02 0.00 0.00 46.19 44.26 1b6f s LEU 114 CO 0.02 0.28 -0.00 -0.75 0.02 0.00 0.00 176.35 175.93 1b6f s LYS 115 N -0.31 1.02 -0.22 1.70 2.20 -0.18 0.13 119.74 124.07 1b6f s LYS 115 Ca 0.07 -0.57 -0.09 0.00 -0.36 0.00 0.00 55.97 55.03 1b6f s LYS 115 Cb -0.12 -2.18 -0.04 0.00 -1.51 0.00 0.00 37.83 33.97 1b6f s LYS 115 CO 0.02 -0.59 0.10 0.42 -0.36 0.00 0.00 175.35 174.94 1b6f s ILE 116 N 1.71 4.90 -0.24 5.43 1.01 0.42 -1.22 121.20 133.21 1b6f s ILE 116 Ca -0.02 0.02 -0.05 0.00 0.00 0.00 0.00 60.65 60.59 1b6f s ILE 116 Cb -0.17 -3.26 -0.01 0.00 0.01 0.00 0.00 42.46 39.03 1b6f s ILE 116 CO -0.07 0.38 0.01 -0.55 0.00 0.00 0.00 174.94 174.71 1b6f s SER 117 N 0.94 4.68 -0.00 3.58 0.15 0.58 0.10 113.70 123.73 1b6f s SER 117 Ca 0.05 -0.37 0.07 0.00 0.70 0.00 0.00 55.95 56.41 1b6f s SER 117 Cb -0.14 -1.82 -0.02 0.00 -1.71 0.00 0.00 66.02 62.33 1b6f s SER 117 CO 0.03 -0.04 -0.23 0.21 1.20 0.00 0.00 173.24 174.41 1b6f s ASN 118 N 1.53 3.38 0.12 5.45 3.04 -1.23 0.21 114.94 127.44 1b6f s ASN 118 Ca 0.06 -0.43 0.08 0.00 0.04 0.00 0.00 52.86 52.61 1b6f s ASN 118 Cb -0.15 -0.47 -0.04 0.00 -1.54 0.00 0.00 41.25 39.05 1b6f s ASN 118 CO -0.00 0.30 -0.20 -0.54 -3.04 0.00 0.00 177.10 173.62 1b6f s LYS 119 N -0.89 1.18 -0.32 0.43 1.02 0.17 -0.47 119.74 120.86 1b6f s LYS 119 Ca 0.11 -1.25 -0.00 0.00 0.02 0.00 0.00 55.97 54.85 1b6f s LYS 119 Cb -0.10 -1.39 0.10 0.00 -0.52 0.00 0.00 37.83 35.92 1b6f s LYS 119 CO 0.01 0.31 0.09 -0.47 -0.92 0.00 0.00 175.35 174.37 1b6f s TYR 120 N -1.45 2.00 -0.55 3.18 6.14 0.33 -2.17 117.35 124.82 1b6f s TYR 120 Ca 0.10 -1.93 -0.24 0.00 0.64 0.00 0.00 57.07 55.64 1b6f s TYR 120 Cb -0.09 -1.89 0.04 0.00 0.42 0.00 0.00 41.96 40.45 1b6f s TYR 120 CO 0.05 -0.89 0.95 -1.01 0.64 0.00 0.00 175.55 175.30 1b6f s HIS 121 N 1.49 2.79 0.45 4.97 3.76 0.42 0.98 115.29 130.15 1b6f s HIS 121 Ca 0.10 0.01 0.06 0.00 -0.15 0.00 0.00 55.06 55.08 1b6f s HIS 121 Cb -0.18 -4.09 -0.02 0.00 1.11 0.00 0.00 32.58 29.39 1b6f s HIS 121 CO -0.22 -1.36 0.23 0.95 -0.85 0.00 0.00 174.74 173.49 1b6f s THR 122 N 3.99 2.05 0.16 1.30 -4.23 -1.26 0.26 115.64 117.92 1b6f s THR 122 Ca 0.31 -1.65 0.06 0.00 -1.18 0.00 0.00 61.69 59.23 1b6f s THR 122 Cb -0.12 -2.71 -0.04 0.00 1.34 0.00 0.00 72.50 70.97 1b6f s THR 122 CO 0.20 0.00 0.05 -0.75 -0.54 0.00 0.00 174.62 173.58 1b6f s LYS 123 N -4.01 2.63 0.27 3.99 2.20 -1.26 -4.61 119.74 118.94 1b6f s LYS 123 Ca 0.36 -0.97 -0.05 0.00 -0.36 0.00 0.00 55.97 54.96 1b6f s LYS 123 Cb 0.02 -2.50 0.53 0.00 -1.51 0.00 0.00 37.83 34.36 1b6f s LYS 123 CO 0.21 0.48 1.61 0.78 -0.36 0.00 0.00 175.35 178.06 1b6f h GLY 124 N 2.70 0.95 0.34 5.54 0.00 -2.01 -1.29 103.07 109.30 1b6f h GLY 124 Ca -0.47 0.15 -0.01 0.00 0.00 0.00 0.00 47.33 47.00 1b6f h GLY 124 CO 0.60 -0.36 -0.42 -0.55 0.00 0.00 0.00 176.54 175.81 1b6f h ASP 125 N 0.07 -1.19 -3.63 0.19 3.32 -2.05 -3.43 116.42 109.70 1b6f h ASP 125 Ca 0.47 0.10 -0.45 0.00 0.02 0.00 0.00 57.03 57.17 1b6f h ASP 125 Cb 0.87 0.40 0.13 0.00 0.22 0.00 0.00 39.33 40.96 1b6f h ASP 125 CO -0.78 -0.53 0.34 -1.00 -1.72 0.00 0.00 179.24 175.55 1b6f s HIS 126 N -5.31 1.79 0.04 4.55 3.76 -0.49 -5.11 115.29 114.53 1b6f s HIS 126 Ca -0.14 0.23 0.00 0.00 -0.15 0.00 0.00 55.06 54.99 1b6f s HIS 126 Cb 0.04 -3.75 -0.00 0.00 1.11 0.00 0.00 32.58 29.97 1b6f s HIS 126 CO 0.49 -2.28 0.05 0.39 -0.85 0.00 0.00 174.74 172.54 1b6f n GLU 127 N -3.46 0.08 -3.89 1.40 1.02 -1.26 -4.26 120.64 110.26 1b6f n GLU 127 Ca 0.14 -0.36 -0.30 0.00 -0.02 0.00 0.00 57.16 56.62 1b6f n GLU 127 Cb 0.60 0.33 -0.14 0.00 -0.02 0.00 0.00 31.44 32.21 1b6f n GLU 127 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 1b6f s VAL 128 N -2.40 2.31 0.24 2.62 1.01 -1.26 -4.97 120.40 117.96 1b6f s VAL 128 Ca 0.04 -3.16 -0.31 0.00 0.00 0.00 0.00 61.98 58.55 1b6f s VAL 128 Cb -0.00 -2.60 -0.12 0.00 0.00 0.00 0.00 36.38 33.66 1b6f s VAL 128 CO 0.03 -0.83 1.68 -0.54 0.00 0.00 0.00 175.10 175.44 1b6f s LYS 129 N -0.16 4.12 0.46 2.72 -0.14 -1.26 -4.81 119.74 120.66 1b6f s LYS 129 Ca 0.17 2.61 0.23 0.00 -1.36 0.00 0.00 55.97 57.62 1b6f s LYS 129 Cb -0.25 -3.05 1.25 0.00 -1.68 0.00 0.00 37.83 34.10 1b6f s LYS 129 CO -0.00 -0.71 1.66 0.00 -0.76 0.00 0.00 175.35 175.54 1b6f h ALA 130 N 6.02 1.17 0.65 5.17 0.00 -1.98 -2.49 119.26 127.81 1b6f h ALA 130 Ca -0.45 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.44 1b6f h ALA 130 Cb 1.21 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 1b6f h ALA 130 CO 0.89 -0.17 -0.46 0.93 0.00 0.00 0.00 179.25 180.44 1b6f h GLU 131 N 0.00 -1.02 -0.02 0.00 5.08 -1.98 2.06 114.58 118.70 1b6f h GLU 131 Ca 0.00 0.07 -0.04 0.00 -1.00 0.00 0.00 59.36 58.39 1b6f h GLU 131 Cb 0.43 0.23 -0.01 0.00 0.50 0.00 0.00 28.75 29.91 1b6f h GLU 131 CO 0.00 -0.68 -0.17 1.96 -1.00 0.00 0.00 179.01 179.12 1b6f h GLN 132 N -1.06 0.02 -0.07 2.33 1.08 -1.82 -0.50 115.11 115.09 1b6f h GLN 132 Ca -0.08 -0.00 -0.05 0.00 -1.45 0.00 0.00 58.65 57.06 1b6f h GLN 132 Cb 0.88 -0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.30 1b6f h GLN 132 CO 0.05 0.20 -0.16 0.28 -0.95 0.00 0.00 178.83 178.24 1b6f h VAL 133 N 0.02 1.42 -0.05 -0.54 2.07 -1.23 -2.69 116.25 115.25 1b6f h VAL 133 Ca 0.00 -1.49 -0.05 0.00 0.82 0.00 0.00 66.70 65.98 1b6f h VAL 133 Cb 0.32 2.21 -0.01 0.00 -1.52 0.00 0.00 31.29 32.29 1b6f h VAL 133 CO 0.02 0.42 -0.23 0.50 0.02 0.00 0.00 177.57 178.30 1b6f h LYS 134 N -0.25 0.08 0.00 1.57 3.64 0.37 -1.41 116.57 120.57 1b6f h LYS 134 Ca 0.00 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 1b6f h LYS 134 Cb 0.76 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.57 1b6f h LYS 134 CO 0.04 0.31 0.00 0.00 -2.27 0.00 0.00 179.45 177.52 1b6f h ALA 135 N 1.70 1.00 -0.14 5.00 0.00 -1.04 -1.81 119.26 123.97 1b6f h ALA 135 Ca 0.01 0.00 -0.14 0.00 0.00 0.00 0.00 54.91 54.79 1b6f h ALA 135 Cb 0.45 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.24 1b6f h ALA 135 CO 0.03 0.00 -0.44 1.03 0.00 0.00 0.00 179.25 179.87 1b6f h SER 136 N 0.00 0.64 0.42 0.00 0.87 -0.91 -3.10 113.55 111.47 1b6f h SER 136 Ca 0.00 -0.60 -0.31 0.00 -1.23 0.00 0.00 61.79 59.65 1b6f h SER 136 Cb 0.62 -0.19 0.02 0.00 -0.44 0.00 0.00 62.40 62.42 1b6f h SER 136 CO 0.00 1.12 -1.37 0.07 -0.53 0.00 0.00 176.83 176.12 1b6f h LYS 137 N 0.18 0.43 0.05 2.24 2.10 -1.50 -1.54 116.57 118.52 1b6f h LYS 137 Ca -0.01 -0.72 0.03 0.00 -2.00 0.00 0.00 60.65 57.94 1b6f h LYS 137 Cb 1.06 0.27 -0.05 0.00 -0.90 0.00 0.00 32.23 32.61 1b6f h LYS 137 CO 0.09 1.34 -0.43 1.49 -2.00 0.00 0.00 179.45 179.95 1b6f h GLU 138 N 0.12 -0.59 0.00 0.07 4.81 -1.41 -0.56 114.58 117.02 1b6f h GLU 138 Ca -0.20 0.04 -0.11 0.00 -0.13 0.00 0.00 59.36 58.96 1b6f h GLU 138 Cb 2.08 0.13 -0.02 0.00 0.63 0.00 0.00 28.75 31.57 1b6f h GLU 138 CO 0.24 -0.39 -0.51 -0.07 -0.73 0.00 0.00 179.01 177.55 1b6f h LEU 139 N -0.61 0.00 -0.34 1.64 3.38 -1.67 -3.26 115.31 114.44 1b6f h LEU 139 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1b6f h LEU 139 Cb 0.67 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.40 1b6f h LEU 139 CO -0.29 0.51 0.22 1.23 0.09 0.00 0.00 178.44 180.20 1b6f h GLY 140 N 2.91 0.49 0.98 0.83 0.00 -0.54 -1.89 103.07 105.85 1b6f h GLY 140 Ca -0.01 -0.19 -0.02 0.00 0.00 0.00 0.00 47.33 47.11 1b6f h GLY 140 CO 0.07 0.19 0.25 -2.09 0.00 0.00 0.00 176.54 174.96 1b6f h GLU 141 N 0.46 0.73 0.00 4.80 4.81 -1.17 -1.58 114.58 122.63 1b6f h GLU 141 Ca 0.13 -0.10 -0.01 0.00 -0.13 0.00 0.00 59.36 59.24 1b6f h GLU 141 Cb -0.02 -0.13 -0.00 0.00 0.63 0.00 0.00 28.75 29.22 1b6f h GLU 141 CO -0.03 0.60 -0.04 1.15 -0.73 0.00 0.00 179.01 179.97 1b6f h THR 142 N 0.68 0.31 0.08 0.32 2.02 -1.54 -0.52 112.91 114.25 1b6f h THR 142 Ca 0.18 -0.22 -0.00 0.00 0.77 0.00 0.00 66.41 67.13 1b6f h THR 142 Cb 0.11 1.17 0.00 0.00 -1.74 0.00 0.00 68.15 67.68 1b6f h THR 142 CO -0.02 0.04 -0.04 -0.07 0.37 0.00 0.00 175.52 175.80 1b6f h LEU 143 N 0.00 -0.09 -1.40 2.58 3.38 -0.47 -0.99 115.31 118.32 1b6f h LEU 143 Ca -0.00 -0.52 -0.06 0.00 0.09 0.00 0.00 57.88 57.39 1b6f h LEU 143 Cb 0.16 0.02 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 1b6f h LEU 143 CO 0.00 0.56 -0.28 0.17 0.09 0.00 0.00 178.44 178.98 1b6f h LEU 144 N -0.82 0.00 -0.29 1.67 8.10 -1.22 -2.31 115.31 120.44 1b6f h LEU 144 Ca -0.01 0.00 -0.17 0.00 0.11 0.00 0.00 57.88 57.81 1b6f h LEU 144 Cb 0.61 0.00 -0.02 0.00 -0.44 0.00 0.00 40.66 40.80 1b6f h LEU 144 CO 0.02 0.28 -0.79 0.03 -4.11 0.00 0.00 178.44 173.86 1b6f h ARG 145 N 0.00 0.00 -0.02 0.17 2.47 -1.12 -2.67 114.38 113.21 1b6f h ARG 145 Ca -0.00 0.00 -0.00 0.00 -1.26 0.00 0.00 59.98 58.71 1b6f h ARG 145 Cb 0.60 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 28.92 1b6f h ARG 145 CO 0.04 0.79 -0.00 0.00 0.56 0.00 0.00 179.97 181.36 1b6f h ALA 146 N 1.21 0.03 -0.73 0.04 0.00 -0.61 -0.10 119.26 119.09 1b6f h ALA 146 Ca -0.01 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.68 1b6f h ALA 146 Cb 1.47 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 19.22 1b6f h ALA 146 CO 0.10 -0.28 0.36 0.28 0.00 0.00 0.00 179.25 179.71 1b6f h VAL 147 N -0.32 1.24 0.06 0.00 2.07 -1.55 0.17 116.25 117.91 1b6f h VAL 147 Ca 0.00 -0.66 -0.00 0.00 0.82 0.00 0.00 66.70 66.87 1b6f h VAL 147 Cb 0.38 0.32 0.00 0.00 -1.52 0.00 0.00 31.29 30.48 1b6f h VAL 147 CO 0.00 0.28 -0.03 -0.08 0.02 0.00 0.00 177.57 177.76 1b6f h GLU 148 N 1.02 -0.07 0.00 1.57 4.81 -1.41 0.35 114.58 120.85 1b6f h GLU 148 Ca 0.25 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.49 1b6f h GLU 148 Cb 0.11 0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.51 1b6f h GLU 148 CO -0.03 0.11 0.00 1.03 -0.73 0.00 0.00 179.01 179.39 1b6f h SER 149 N -0.24 0.00 0.31 1.04 0.87 -0.81 -2.56 113.55 112.15 1b6f h SER 149 Ca -0.01 0.00 -0.33 0.00 -1.23 0.00 0.00 61.79 60.22 1b6f h SER 149 Cb 0.22 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 62.19 1b6f h SER 149 CO 0.01 0.00 -1.60 0.22 -0.53 0.00 0.00 176.83 174.93 1b6f h TYR 150 N 0.00 0.70 0.30 2.24 3.20 0.15 -3.30 116.97 120.26 1b6f h TYR 150 Ca 0.00 -0.51 -0.01 0.00 3.14 0.00 0.00 58.73 61.35 1b6f h TYR 150 Cb 0.31 -0.03 0.00 0.00 1.54 0.00 0.00 36.73 38.55 1b6f h TYR 150 CO 0.00 1.55 -0.15 -0.07 -1.64 0.00 0.00 178.16 177.85 1b6f h LEU 151 N 0.10 -0.35 -1.77 2.82 3.38 -0.57 -2.89 115.31 116.03 1b6f h LEU 151 Ca -0.28 -0.19 0.26 0.00 0.09 0.00 0.00 57.88 57.76 1b6f h LEU 151 Cb 2.09 0.09 -0.04 0.00 0.09 0.00 0.00 40.66 42.89 1b6f h LEU 151 CO 0.20 0.07 0.82 0.25 0.09 0.00 0.00 178.44 179.87 1b6f h LEU 152 N -0.84 0.00 -3.34 1.67 6.46 -1.65 1.54 115.31 119.14 1b6f h LEU 152 Ca -0.04 0.00 -0.10 0.00 -0.12 0.00 0.00 57.88 57.62 1b6f h LEU 152 Cb 0.52 0.00 -0.06 0.00 -0.73 0.00 0.00 40.66 40.39 1b6f h LEU 152 CO 0.07 0.00 0.13 0.00 -0.62 0.00 0.00 178.44 178.02 1b6f n ALA 153 N -2.50 4.05 -0.08 1.25 0.00 -1.10 -2.13 120.51 120.00 1b6f n ALA 153 Ca 0.19 -1.86 -0.08 0.00 0.00 0.00 0.00 53.44 51.69 1b6f n ALA 153 Cb 1.12 -1.18 -0.03 0.00 0.00 0.00 0.00 19.45 19.37 1b6f n ALA 153 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 1b6f n HIS 154 N 0.21 0.57 -2.78 0.00 -0.00 0.52 -4.69 115.22 109.06 1b6f n HIS 154 Ca 0.30 0.25 -0.01 0.00 -0.00 0.00 0.00 57.72 58.26 1b6f n HIS 154 Cb 1.18 -0.71 0.07 0.00 -0.00 0.00 0.00 29.99 30.53 1b6f n HIS 154 CO 0.00 0.00 0.00 0.43 -0.00 0.00 0.00 176.34 176.77 1b6f n SER 155 N -4.54 0.69 0.00 0.26 7.64 -1.26 -4.88 113.62 111.54 1b6f n SER 155 Ca -0.13 -2.13 0.00 0.00 1.01 0.00 0.00 58.87 57.62 1b6f n SER 155 Cb 0.40 -0.14 0.00 0.00 -1.01 0.00 0.00 64.21 63.46 1b6f n SER 155 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 1b6f n ASP 156 N -0.81 0.05 -0.04 6.43 2.03 -1.25 -4.97 116.55 118.00 1b6f n ASP 156 Ca 0.00 0.00 -0.01 0.00 0.52 0.00 0.00 54.79 55.30 1b6f n ASP 156 Cb 0.82 0.00 -0.00 0.00 -0.72 0.00 0.00 41.12 41.22 1b6f n ASP 156 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1b6f h ALA 157 N 0.00 0.00 -4.54 -1.67 0.00 -1.76 -3.48 119.26 107.80 1b6f h ALA 157 Ca 0.00 -0.15 -0.39 0.00 0.00 0.00 0.00 54.91 54.37 1b6f h ALA 157 Cb 0.07 0.12 0.07 0.00 0.00 0.00 0.00 17.79 18.04 1b6f h ALA 157 CO 0.00 0.12 -0.60 0.66 0.00 0.00 0.00 179.25 179.43 1b6f n TYR 158 N -3.75 -2.05 -0.10 0.00 4.02 -1.26 -5.10 117.16 108.92 1b6f n TYR 158 Ca -0.02 0.58 0.00 0.00 -0.01 0.00 0.00 57.90 58.46 1b6f n TYR 158 Cb 0.06 -4.49 0.00 0.00 -0.02 0.00 0.00 39.34 34.89 1b6f n TYR 158 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 176.86 174.14